N6-(3-chloranyl-4-methyl-phenyl)-N4-(6-methylpyridin-2-yl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-(3-chloranyl-4-methyl-phenyl)-N4-(6-methylpyridin-2-yl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-(3-chloro-4-methyl-phenyl)-N4-(6-methyl-2-pyridyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(3-chloro-4-methylphenyl)-N4-(6-methyl-2-pyridinyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-(3-chloro-4-methylphenyl)-4-N-(6-methylpyridin-2-yl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(3-chloro-4-methyl-anilino)-5-nitro-pyrimidin-4-yl]-(6-methyl-2-pyridyl)amine Formula: C17H15ClN6O2 MolecularWeight: 370.793

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=CC(=N3)C)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=CC(=N3)C)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H15ClN6O2/c1-10-6-7-12(8-13(10)18)22-16-15(24(25)26)17(20-9-19-16)23-14-5-3-4-11(2)21-14/h3-9H,1-2H3,(H2,19,20,21,22,23)